SCHEMBL6095092

SCHEMBL6095092

O=c1cc(C(F)(F)F)c2cc(Cc3ccc(NC(=S)NCCN4CCOCC4)cc3)ccc2[nH]1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.52
KMT2A Q03164 2/20 0.52
KDM4E B2RXH2 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.49
GAA P10253 3/20 0.48
MAPT P10636 1/20 0.48
ALDH1A1 P00352 3/20 0.47
PKM P14618 1/20 0.47
NPC1 O15118 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C19 P33261 1/20 0.47
MEN1 O00255 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
MAPK1 P28482 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
RECQL P46063 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6097934 0.81 KDM4E (0.54) LMNAKMT2AKDM4ESMN1; SMN2GAA
SCHEMBL5860444 0.80 EPHX2 (0.49) KMT2AGAAMAPTALDH1A1PKM
SCHEMBL6096544 0.80 MAPT (0.51) LMNAKMT2AKDM4ESMN1; SMN2GAA
SCHEMBL6097519 0.80 LMNA (0.50) LMNAKMT2AKDM4ESMN1; SMN2GAA
SCHEMBL6098243 0.80 LMNA (0.56) LMNAKDM4EGAA
SCHEMBL6095168 0.80 LMNA (0.48) LMNAKDM4E
SCHEMBL6096595 0.79 AR (0.53) LMNAKMT2ASMN1; SMN2GAAMAPT
SCHEMBL6095163 0.78 MEN1 (0.52) LMNAKMT2ASMN1; SMN2GAAMAPT
SCHEMBL6096023 0.77 SMN1; SMN2 (0.56) LMNAKMT2AKDM4ESMN1; SMN2GAA
SCHEMBL6112427 0.77 LMNA (0.54) LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7115745-B2 Benzyl urea and thiourea derivatives WARNER LAMBERT COMPANY LLC (US) 2006-10-03 US claimed
US-7115745-B2 Benzyl urea and thiourea derivatives WARNER LAMBERT COMPANY LLC (US) 2006-10-03 US disclosed
EP-1597233-A1 BENZYL UREA AND THIOUREA DERIVATIVES USEFUL AS ANDROGEN ANTAGONISTS Warner-Lambert Company LLC (US) 2005-11-23 EP disclosed
US-20050107427-A1 Benzyl urea and thiourea derivatives DU DANIEL Y (US) 2005-05-19 US disclosed
WO-2004072043-A1 BENZYL UREA AND THIOUREA DERIVATIVES USEFUL AS ANDROGEN ANTAGONISTS WARNER-LAMBERT COMPANY LLC (US) 2004-08-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050107427-A1 Benzyl urea and thiourea derivatives BRDT, TAS2R8, FSHR LMNA 4794/4885KMT2A 2199/4885KDM4E 1959/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.